SCHEMBL13700489

SCHEMBL13700489

CCC1CC(=O)N(OC(=O)Cl)C1=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
MME P08473 1/20 0.31
MT-CO2 P00403 1/20 0.31
ALOX5 P09917 1/20 0.31
BRD4 O60885 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14363440 0.86 CYP2C19 (0.42) CYP2C19MMEMT-CO2ALOX5BRD4
SCHEMBL3684074 0.85 CYP2C19 (0.41) CYP2C19MMEMT-CO2ALOX5BRD4
SCHEMBL18036536 0.85 CYP2C19 (0.44) CYP2C19MMEMT-CO2ALOX5BRD4
SCHEMBL17236079 0.81 CYP2C19 (0.42) CYP2C19MMEMT-CO2ALOX5
SCHEMBL13657270 0.81 CYP2C19 (0.39) CYP2C19MMEMT-CO2ALOX5
SCHEMBL868201 0.75
SCHEMBL14389158 0.75 CYP2C19 (0.35) CYP2C19
SCHEMBL13657219 0.74 SMN1; SMN2 (0.36) CYP2C19MT-CO2ALOX5
SCHEMBL14389157 0.72
SCHEMBL14281129 0.71 PTGS1 (0.38) CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585925-B2 Method of producing a polymer network DR. GOTTSCHALL INSTRUCTION GESELLSCHAFT FUR TECHNISCHE CHROMATOGRAPHIE MBH (DE) 2009-09-08 US disclosed
US-20080058501-A1 Method of Producing a Polymer Network GOTTSCHALL KLAUS 2008-03-06 US disclosed
US-7291686-B1 Method of producing polymer network DR. GOTTSCHALL INSTRUCTION GESELLSCHAFT FUR TECHNISCHE CHROMATOGRAPHIE MBH (DE) 2007-11-06 US disclosed